2-[[1-(5-chloranyl-2-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-quinoxalin-6-yl-ethanamide

Systemtic Name: 2-[[1-(5-chloranyl-2-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-quinoxalin-6-yl-ethanamide Openeye Name: 2-[1-(5-chloro-2-methyl-phenyl)tetrazol-5-yl]sulfanyl-N-quinoxalin-6-yl-acetamide CAS Name: 2-[[1-(5-chloro-2-methylphenyl)-5-tetrazolyl]thio]-N-(6-quinoxalinyl)acetamide IUPAC Name: 2-[1-(5-chloro-2-methylphenyl)tetrazol-5-yl]sulfanyl-N-quinoxalin-6-ylacetamide Traditional Name: 2-[[1-(5-chloro-2-methyl-phenyl)tetrazol-5-yl]thio]-N-quinoxalin-6-yl-acetamide Formula: C18H14ClN7OS MolecularWeight: 411.86806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2C(=NN=N2)SCC(=O)NC3=CC4=NC=CN=C4C=C3

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2C(=NN=N2)SCC(=O)NC3=CC4=NC=CN=C4C=C3

InChI

InChI=1S/C18H14ClN7OS/c1-11-2-3-12(19)8-16(11)26-18(23-24-25-26)28-10-17(27)22-13-4-5-14-15(9-13)21-7-6-20-14/h2-9H,10H2,1H3,(H,22,27)